Chemical Properties of endo-Tricyclo[6,2,1,0(2,6)]dec-3-en-8-one

InChI

InChI=1S/C10H12O/c11-10-5-6-4-9(10)8-3-1-2-7(6)8/h1-2,6-9H,3-5H2/t6?,7-,8-,9?/m1/s1

InChI Key

BNISRVGIGGHBIM-OMRMXDSLSA-N

Formula

C10H12O

SMILES

O=C1CC2CC1C1CC=CC21

Molecular Weight¹

148.20

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfG°	103.13	kJ/mol	Joback Calculated Property
ΔfH°gas	-137.75	kJ/mol	Joback Calculated Property
ΔfusH°	15.76	kJ/mol	Joback Calculated Property
ΔvapH°	42.00	kJ/mol	Joback Calculated Property
log10WS	-1.86		Crippen Calculated Property
logPoct/wat	1.788		Crippen Calculated Property
McVol	116.450	ml/mol	McGowan Calculated Property
Pc	3360.64	kPa	Joback Calculated Property
Inp	[1263.00; 1263.00]
Inp	1263.00		NIST
Inp	1263.00		NIST
I	1828.00		NIST
Tboil	515.00	K	Joback Calculated Property
Tc	748.55	K	Joback Calculated Property
Tfus	317.50	K	Joback Calculated Property
Vc	0.451	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[292.87; 385.43]	J/mol×K	[515.00; 748.55]
Cp,gas	292.87	J/mol×K	515.00	Joback Calculated Property
Cp,gas	311.24	J/mol×K	553.92	Joback Calculated Property
Cp,gas	328.32	J/mol×K	592.85	Joback Calculated Property
Cp,gas	344.19	J/mol×K	631.77	Joback Calculated Property
Cp,gas	358.94	J/mol×K	670.70	Joback Calculated Property
Cp,gas	372.66	J/mol×K	709.62	Joback Calculated Property
Cp,gas	385.43	J/mol×K	748.55	Joback Calculated Property

Similar Compounds

Find more compounds similar to endo-Tricyclo[6,2,1,0(2,6)]dec-3-en-8-one.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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